8QMJ
Crystal structure of Paradendryphiella salina PL7C alginate lyase mutant H124 soaked with hexa-mannuronic acid
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ESRF BEAMLINE ID30B |
| Synchrotron site | ESRF |
| Beamline | ID30B |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2020-09-06 |
| Detector | DECTRIS EIGER X 9M |
| Wavelength(s) | 0.65 |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 77.350, 38.750, 75.010 |
| Unit cell angles | 90.00, 116.90, 90.00 |
Refinement procedure
| Resolution | 34.490 - 0.980 |
| R-factor | 0.1343 |
| Rwork | 0.134 |
| R-free | 0.15720 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.004 |
| RMSD bond angle | 0.897 |
| Data reduction software | XDS |
| Data scaling software | XDS |
| Phasing software | PHASER |
| Refinement software | PHENIX (dev_4788) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 34.490 | 1.000 |
| High resolution limit [Å] | 0.980 | 0.980 |
| Number of reflections | 113955 | 7531 |
| <I/σ(I)> | 13.16 | 0.94 |
| Completeness [%] | 99.9 | |
| Redundancy | 6.9 | |
| CC(1/2) | 1.000 | 0.370 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 5.5 | 293 | 30% PEG3350, 0.1M Bis-Tris pH 5.5, 0.2M NaCl |
